Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 1/20 | 0.56 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 2/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.40 |
| ▸ | IP6K1 | Q92551 | 3/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | XDH | P47989 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 4/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL25349620 | 0.78 | PDPK1 (0.42) | SRCPDPK1ALDH1A1HPGDLMNA | |
| SCHEMBL28798580 | 0.76 | KDM4E (0.46) | IP6K1ALDH1A1HPGDPARP1LMNA | |
| SCHEMBL857725 | 0.71 | SRC (0.54) | SRCCHEK1PIM1AKT1FLT3 | |
| SCHEMBL21339749 | 0.70 | SRC (0.52) | SRCCHEK1PIM1IP6K1PDPK1 | |
| SCHEMBL31728873 | 0.69 | PARP1 (0.49) | SRCCHEK1PIM1AKT1FLT3 | |
| SCHEMBL23832157 | 0.68 | MMP12 (0.38) | SRCCHEK1PIM1AKT1FLT3 | |
| SCHEMBL22029115 | 0.68 | CHEK1 (0.51) | SRCCHEK1PIM1AKT1FLT3 | |
| SCHEMBL30591004 | 0.68 | CHEK1 (0.51) | SRCCHEK1PIM1AKT1FLT3 | |
| SCHEMBL13187699 | 0.68 | HPGD (0.47) | SRCPDPK1ALDH1A1XDHHPGD | |
| SCHEMBL15845860 | 0.68 | PARP1 (0.44) | SRCCHEK1PIM1AKT1FLT3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114539245-A | Pyrimidine-fused ring derivative-containing regulator, and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-05-27 | — | — | CN | disclosed |